SCHEMBL14083900

SCHEMBL14083900

O=C(Nc1ccc(-c2cnco2)cc1)c1ccc(-c2ncccc2Cl)cc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.69
▸ KDM4E B2RXH2 3/20 0.69
▸ PKM P14618 2/20 0.69
▸ RAB9A P51151 3/20 0.65
▸ ALDH1A1 P00352 2/20 0.65
▸ LMNA P02545 1/20 0.65
▸ TRPV1 Q8NER1 13/20 0.64
▸ HTT P42858 1/20 0.58
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ TRPV4 Q9HBA0 1/20 0.52
▸ MAPK1 P28482 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14083063 0.89 NPC1 (0.57) NPC1KDM4EPKMRAB9AALDH1A1
SCHEMBL14083722 0.86 NPC1 (0.57) NPC1KDM4EPKMRAB9AALDH1A1
SCHEMBL14083851 0.85 KDM4E (0.55) NPC1KDM4EPKMRAB9AALDH1A1
SCHEMBL14083470 0.82 TRPV1 (0.77) KDM4ETRPV1MEN1KMT2ATRPV4
SCHEMBL14082841 0.82 TRPV1 (0.77) TRPV1KMT2ATRPV4MAPK1
SCHEMBL14083467 0.81 TRPV1 (0.75) NPC1RAB9ALMNATRPV1TRPV4
SCHEMBL14083879 0.80 TRPV1 (0.78) TRPV1TRPV4
SCHEMBL3872091 0.80 TRPV1 (0.78) NPC1RAB9ATRPV1TRPV4
SCHEMBL14083469 0.80 TRPV1 (0.78) TRPV1TRPV4
SCHEMBL14083471 0.80 TRPV1 (0.67) NPC1KDM4ERAB9ALMNATRPV1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 NPC1 1061/4885KDM4E 4231/4885PKM 2195/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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